(2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol

C11H19N3O — CID 80559133

IUPAC(2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol
SMILESCCn1nccc1C(O)C1CCCNC1
InChIInChI=1S/C11H19N3O/c1-2-14-10(5-7-13-14)11(15)9-4-3-6-12-8-9/h5,7,9,11-12,15H,2-4,6,8H2,1H3
InChIKeyBLQAXJQOCWZEIY-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.94
Rot. Bonds3

About (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol

(2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol (PubChem CID 80559133) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol.

Molecular Properties

Compound Name(2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol
PubChem CID80559133
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name(2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol
SMILESCCn1nccc1C(O)C1CCCNC1
InChIInChI=1S/C11H19N3O/c1-2-14-10(5-7-13-14)11(15)9-4-3-6-12-8-9/h5,7,9,11-12,15H,2-4,6,8H2,1H3
InChIKeyBLQAXJQOCWZEIY-UHFFFAOYSA-N
XLogP0.94
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

azepan-2-yl-(2-ethylpyrazol-3-yl)methanol
CID 114556898
1-cyclopropyl-2-(2-ethylpyrazol-3-yl)ethane-1,2-diol
CID 103456908
(2,2-dimethylcyclopentyl)-(2-ethylpyrazol-3-yl)methanol
CID 107192287
cyclooctyl-(2-ethylpyrazol-3-yl)methanamine
CID 80604016
(5-ethylthiophen-2-yl)-piperidin-3-ylmethanol
CID 43146513
(R)-phenyl-[(3S)-piperidin-3-yl]methanol
CID 39238461
oxan-3-yl-(2-propylpyrazol-3-yl)methanol
CID 63977183
(4-methylphenyl)-piperidin-3-ylmethanol
CID 43146496
[4-chloro-1-[2-(dimethylamino)ethyl]pyrazol-5-yl]-piperidin-3-ylmethanol
CID 114637159
azepan-2-yl-(2-propylpyrazol-3-yl)methanol
CID 114557083
[4-(2-methylbutan-2-yl)phenyl]-piperidin-3-ylmethanol
CID 66259760
1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naphthalen-1-yl-(2-ethylpyrazol-3-yl)methanol
CID 115798870

Frequently Asked Questions

What is the IUPAC name of (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol?
The IUPAC name of (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol (CID 80559133) is (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol.
What is the SMILES notation for (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol?
The canonical SMILES for (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol is CCn1nccc1C(O)C1CCCNC1.
What is the InChIKey of (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol?
The InChIKey is BLQAXJQOCWZEIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-14-10(5-7-13-14)11(15)9-4-3-6-12-8-9/h5,7,9,11-12,15H,2-4,6,8H2,1H3.
What are the key properties of (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol?
(2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol has a molecular weight of 209.29 g/mol, XLogP of 0.94, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpyrazol-3-yl)-piperidin-3-ylmethanol is sourced from PubChem (CID 80559133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).